diethyl 5-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(6-phthalimidohexanoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C25H28N2O7S MolecularWeight: 500.56402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C25H28N2O7S/c1-4-33-24(31)19-15(3)20(25(32)34-5-2)35-21(19)26-18(28)13-7-6-10-14-27-22(29)16-11-8-9-12-17(16)23(27)30/h8-9,11-12H,4-7,10,13-14H2,1-3H3,(H,26,28)